SCHEMBL4070857

SCHEMBL4070857

O=S(=O)(O)c1ccc(-n2ncc(N=Nc3ccccc3)c2O)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C19 P33261 1/20 0.46
GLO1 Q04760 1/20 0.44
RPS6KA3 P51812 1/20 0.42
ATIC P31939 1/20 0.40
SENP2 Q9HC62 3/20 0.38
SENP1 Q9P0U3 3/20 0.38
SUMO2 P61956 2/20 0.38
SUMO1 P63165 2/20 0.38
SENP7 Q9BQF6 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 1/20 0.38
PTGS2 P35354 6/20 0.37
PTGS1 P23219 4/20 0.37
PHLPP2 Q6ZVD8 3/20 0.37
ALOX5 P09917 1/20 0.36
CYP1A2 P05177 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12854629 1.00 POLB (0.55) POLBCYP2D6CYP2C19GLO1RPS6KA3
SCHEMBL12126424 0.93 RPS6KA3 (0.48) POLBCYP2D6CYP2C19GLO1RPS6KA3
SCHEMBL29805379 0.92 RPS6KA3 (0.47) POLBCYP2D6CYP2C19GLO1RPS6KA3
SCHEMBL8965768 0.85 NPC1 (0.46) CYP2C19GLO1SENP7SMN1; SMN2PTGS1
SCHEMBL8999319 0.85 NPC1 (0.46) CYP2C19GLO1SENP7SMN1; SMN2PTGS1
SCHEMBL4075897 0.81 FTO (0.48) POLBCYP2D6CYP2C19GLO1SMN1; SMN2
SCHEMBL15298089 0.81 FTO (0.48) POLBCYP2D6CYP2C19GLO1SMN1; SMN2
SCHEMBL13557905 0.75 CYP2C19 (0.55) POLBCYP2D6CYP2C19GLO1RPS6KA3
SCHEMBL13901018 0.74 POLB (0.51) POLBCYP2D6CYP2C19GLO1SMN1; SMN2
SCHEMBL5408685 0.74 PTGS2 (0.51) POLBCYP2D6GLO1RPS6KA3SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11656182-B2 Method, composition, and chip for detecting analyte in blood sample TERUMO KABUSHIKI KAISHA (JP) 2023-05-23 US disclosed
US-8790544-B2 Liquid-crystalline coating solution and polarizing film NITTO DENKO CORPORATION (JP) 2014-07-29 US disclosed
US-20120105795-A1 LIQUID-CRYSTALLINE COATING SOLUTION AND POLARIZING FILM NITTO DENKO CORPORATION (JP) 2012-05-03 US disclosed